Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03264761
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
---|---|---|---|---|---|
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
PTU![]() | 2-ETHYL-1-PHENYL-ISOTHIOUREA | A,B | 1K2T | 0.83 | ![]() |
PTU![]() | 2-ETHYL-1-PHENYL-ISOTHIOUREA | A,B | 1D1V | 0.83 | ![]() |
CIU![]() | N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA | A,B | 1EK1 | 0.7 | ![]() |
CIU![]() | N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA | A | 1VJ5 | 0.7 | ![]() |
AU4![]() | 4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE) | A | 2PYZ | 0.72 | ![]() |
1MR![]() | N-METHYLANILINE | X | 2OTZ | 0.77 | ![]() |
TYX![]() | S-(2-ANILINO-2-OXOETHYL)-L-CYSTEINE | A | 2PQT | 0.71 | ![]() |
UFO![]() | 1-(1,4-dimethyl-1,2,3,4-tetrahydroquinoxalin- 6-yl)methanamine | A,B,D | 3GQT | 0.71 | ![]() |
FOE![]() | 2-(2-AMINO-3-OXO-PROPYLSULFANYL)- N-(4-FLUORO-PHENYL)-N-ISOPROPYL- ACETAMIDE | B | 1BX9 | 0.73 | ![]() |
PL0![]() | 1-phenylguanidine | A | 2O8W | 0.76 | ![]() |
264![]() | (phenylamino)acetonitrile | A | 2RBN | 0.79 | ![]() |
URS![]() | N-PHENYLTHIOUREA | A,B | 1BUG | 0.73 | ![]() |
OSP![]() | SULTHIAME | A | 2Q1Q | 0.74 | ![]() |
TFM![]() | S-ETHYL-N-[4-(TRIFLUOROMETHYL)PHENYL]ISOTHIOUREA | A,B | 1K2U | 0.74 | ![]() |
NYL![]() | N-ALLYL-ANILINE | A | 1OVK | 0.79 | ![]() |
T2D![]() | 1,2,5-THIADIAZOLIDIN-3-ONE-1,1- DIOXIDE | A | 2BGE | 0.71 | ![]() |
ZMG![]() | (5R)-2-[(2-fluorophenyl)amino]- 5-(1-methylethyl)-1,3-thiazol-4(5H)- one | A,B,C,D | 2RBE | 0.72 | ![]() |
171![]() | 2-PHENYLAMINO-ETHANESULFONIC ACID | A,B | 1SXG | 0.77 | ![]() |